SCHEMBL13061923

SCHEMBL13061923

CCNC(=O)C(N)C(C)O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 4/20 0.41
CTSC P53634 1/20 0.40
TARS1 P26639 2/20 0.36
TSHR P16473 2/20 0.36
ANPEP P15144 1/20 0.35
DNPEP Q9ULA0 1/20 0.35
DPP7 Q9UHL4 1/20 0.33
USP2 O75604 1/20 0.33
SLC15A1 P46059 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15941776 1.00 SPHK1 (0.41) SPHK1CTSCTARS1TSHRANPEP
SCHEMBL14611830 1.00 SPHK1 (0.41) SPHK1CTSCTARS1TSHRANPEP
SCHEMBL15941449 1.00 SPHK1 (0.41) SPHK1CTSCTARS1TSHRANPEP
Hydrochloric Acid SCHEMBL15941251 0.98 SPHK1 (0.40) SPHK1CTSCTARS1TSHRANPEP
Hydrochloric Acid SCHEMBL15941253 0.98 SPHK1 (0.40) SPHK1CTSCTARS1TSHRANPEP
SCHEMBL8265865 0.84 DPP4 (0.47) TSHRDPP7USP2SLC15A1MMP1
SCHEMBL17832776 0.84 DPP4 (0.47) TSHRDPP7USP2SLC15A1MMP1
SCHEMBL12257899 0.84 DPP4 (0.47) TSHRDPP7USP2SLC15A1MMP1
SCHEMBL14611659 0.81 SPHK1 (0.38) SPHK1CTSCTARS1TSHRANPEP
SCHEMBL12259750 0.80 TERT (0.46) TSHRDPP7USP2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100323990-A1 SHIP 1 MODULATOR PRODRUGS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2010-12-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100323990-A1 SHIP 1 MODULATOR PRODRUGS PPM1D, PPM1G, PPM1F SPHK1 1016/4885CTSC 1477/4885TARS1 947/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.